N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-4-methoxy-benzamide

Systemtic Name: N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-4-methoxy-benzamide Openeye Name: N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-4-methoxy-benzamide CAS Name: N-[3-[[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]propyl]-4-methoxybenzamide IUPAC Name: N-[3-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropyl]-4-methoxybenzamide Traditional Name: N-[3-[[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]propyl]-4-methoxy-benzamide Formula: C20H24F3N3O2S MolecularWeight: 427.48367

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCCCNC(=O)C2=CC=C(C=C2)OC)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCCCNC(=O)C2=CC=C(C=C2)OC)C(F)(F)F

InChI

InChI=1S/C20H24F3N3O2S/c1-19(2,3)15-12-16(20(21,22)23)26-18(25-15)29-11-5-10-24-17(27)13-6-8-14(28-4)9-7-13/h6-9,12H,5,10-11H2,1-4H3,(H,24,27)